SCHEMBL30989822

SCHEMBL30989822

CN(Cc1cccc(F)c1F)C(=O)c1cc(Cl)cnc1OC(F)F

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.42
▸ NLRP3 Q96P20 4/20 0.37
▸ HTT P42858 1/20 0.36
▸ PTGER4 P35408 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ SCN9A Q15858 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAP3K7 O43318 1/20 0.34
▸ TAB1 Q15750 1/20 0.34
▸ MDM2 Q00987 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ MAPT P10636 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30989870 0.90 RIPK1 (0.43) RIPK1NLRP3HTTKMT2AMEN1
SCHEMBL30989973 0.89 RIPK1 (0.44) RIPK1NLRP3KMT2AMEN1ATM
SCHEMBL30989967 0.89 RIPK1 (0.44) RIPK1NLRP3KMT2AMEN1ATM
SCHEMBL30989925 0.85 RIPK1 (0.42) RIPK1NLRP3HTTPTGER4SCN9A
SCHEMBL30989923 0.83 ALDH1A1 (0.47) RIPK1HTTPTGER4KMT2AMEN1
SCHEMBL30989806 0.82 GRM5 (0.45) RIPK1HTTKMT2AMEN1HSP90AA1
SCHEMBL30989812 0.82 MEP1B (0.44) RIPK1HTTKMT2AMEN1HSP90AA1
SCHEMBL30989857 0.81 HSP90AA1 (0.52) HTTKMT2AHSP90AA1
SCHEMBL30989808 0.80 HTT (0.39) HTTPTGER4ATMSCN9AHSP90AA1
SCHEMBL30989922 0.79 POLB (0.49) RIPK1KMT2AMEN1ALDH1A1LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4612131-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2025-09-10 — — EP claimed
WO-2024095003-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2024-05-10 — — WO claimed
EP-4612131-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2025-09-10 — — EP disclosed
WO-2024095003-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2024-05-10 — — WO disclosed
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